ethyl 1-ethyl-4-{3-[(2-ethylphenyl)carbamamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-4-{3-[(2-ethylphenyl)carbamamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-4-{3-[(2-ethylphenyl)carbamamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V004-9481 |
| Compound Name: | ethyl 1-ethyl-4-{3-[(2-ethylphenyl)carbamamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C25 H30 N4 O3 S |
| Smiles: | CCc1ccccc1NC(Nc1cccc(c1)C1C(=C(C)N(CC)C(N1)=S)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1889 |
| logD: | 5.1888 |
| logSw: | -4.9495 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.83 |
| InChI Key: | MMDIRWMUARUDMK-JOCHJYFZSA-N |